4-phenyl-6-propan-2-yl-1,3,5-triazin-2-amine

C12H14N4 — CID 63868472

IUPAC4-phenyl-6-propan-2-yl-1,3,5-triazin-2-amine
SMILESCC(C)c1nc(N)nc(-c2ccccc2)n1
InChIInChI=1S/C12H14N4/c1-8(2)10-14-11(16-12(13)15-10)9-6-4-3-5-7-9/h3-8H,1-2H3,(H2,13,14,15,16)
InChIKeyHEGPBOZOOIGWLD-UHFFFAOYSA-N
MW214.27 g/mol
LogP2.24
Rot. Bonds2

About 4-phenyl-6-propan-2-yl-1,3,5-triazin-2-amine

4-phenyl-6-propan-2-yl-1,3,5-triazin-2-amine (PubChem CID 63868472) has the molecular formula C12H14N4 and a molecular weight of 214.27 g/mol. Its IUPAC name is 4-phenyl-6-propan-2-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-phenyl-6-propan-2-yl-1,3,5-triazin-2-amine
PubChem CID63868472
Molecular FormulaC12H14N4
Molecular Weight214.27 g/mol
Exact Mass214.12
IUPAC Name4-phenyl-6-propan-2-yl-1,3,5-triazin-2-amine
SMILESCC(C)c1nc(N)nc(-c2ccccc2)n1
InChIInChI=1S/C12H14N4/c1-8(2)10-14-11(16-12(13)15-10)9-6-4-3-5-7-9/h3-8H,1-2H3,(H2,13,14,15,16)
InChIKeyHEGPBOZOOIGWLD-UHFFFAOYSA-N
XLogP2.24
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,4-bis[3-[4,6-di(propan-2-yl)-1,3,5-triazin-2-yl]phenyl]-6-phenyl-1,3,5-triazine
CID 176842994
2,4-diphenyl-6-[4-[4-phenyl-6-[3-(4-phenyl-6-propan-2-yl-1,3,5-triazin-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3,5-triazine
CID 176843198
4-(2-bromophenyl)-6-propan-2-yl-1,3,5-triazin-2-amine
CID 63867300
4-propan-2-yl-6-pyridin-2-yl-1,3,5-triazin-2-amine
CID 63868334
4-(4-ethylsulfanylphenyl)-6-propan-2-yl-1,3,5-triazin-2-amine
CID 106850120
4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-amine
CID 22352251
4-(3,5-difluorophenyl)-6-propan-2-yl-1,3,5-triazin-2-amine
CID 55251714
2-naphthalen-2-yl-4-(4-phenylphenyl)-6-propan-2-yl-1,3,5-triazine
CID 159185452
4-(4-methylquinolin-2-yl)-6-propan-2-yl-1,3,5-triazin-2-amine
CID 114755549
4-(3-methyl-2-pyridinyl)-6-propan-2-yl-1,3,5-triazin-2-amine
CID 63868866
4-(1-ethoxy-2,2-dimethylpropyl)-6-phenyl-1,3,5-triazin-2-amine
CID 116734103
2-[3-[4,6-di(propan-2-yl)-1,3,5-triazin-2-yl]phenyl]-4-[3-phenyl-4-(4-phenyl-6-propan-2-yl-1,3,5-triazin-2-yl)phenyl]-6-propan-2-yl-1,3,5-triazine
CID 176842988

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-6-propan-2-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-phenyl-6-propan-2-yl-1,3,5-triazin-2-amine (CID 63868472) is 4-phenyl-6-propan-2-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-phenyl-6-propan-2-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-phenyl-6-propan-2-yl-1,3,5-triazin-2-amine is CC(C)c1nc(N)nc(-c2ccccc2)n1.
What is the InChIKey of 4-phenyl-6-propan-2-yl-1,3,5-triazin-2-amine?
The InChIKey is HEGPBOZOOIGWLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4/c1-8(2)10-14-11(16-12(13)15-10)9-6-4-3-5-7-9/h3-8H,1-2H3,(H2,13,14,15,16).
What are the key properties of 4-phenyl-6-propan-2-yl-1,3,5-triazin-2-amine?
4-phenyl-6-propan-2-yl-1,3,5-triazin-2-amine has a molecular weight of 214.27 g/mol, XLogP of 2.24, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-6-propan-2-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 63868472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).